4G4M
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![BU of 4g4m by Molmil](/molmil-images/mine/4g4m) | Crystal structure of the de novo designed fluorinated peptide alpha4F3(6-13) | 分子名称: | 1,2-ETHANEDIOL, TETRAETHYLENE GLYCOL, alpha4F3(6-13) | 著者 | Buer, B.C, Meagher, J.L, Stuckey, J.A, Marsh, E.N.G. | 登録日 | 2012-07-16 | 公開日 | 2012-10-31 | 最終更新日 | 2017-11-15 | 実験手法 | X-RAY DIFFRACTION (1.48 Å) | 主引用文献 | Comparison of the structures and stabilities of coiled-coil proteins containing hexafluoroleucine and t-butylalanine provides insight into the stabilizing effects of highly fluorinated amino acid side-chains. Protein Sci., 21, 2012
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4G2W
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![BU of 4g2w by Molmil](/molmil-images/mine/4g2w) | Crystal structure of PDE5A in complex with its inhibitor | 分子名称: | 5,6-diethyl-2-{5-[(4-methylpiperazin-1-yl)sulfonyl]-2-propoxyphenyl}pyrimidin-4(3H)-one, DI(HYDROXYETHYL)ETHER, MAGNESIUM ION, ... | 著者 | Ren, J, Chen, T.T, Xu, Y.C. | 登録日 | 2012-07-13 | 公開日 | 2013-06-26 | 最終更新日 | 2023-11-08 | 実験手法 | X-RAY DIFFRACTION (2.28 Å) | 主引用文献 | Design, synthesis, and pharmacological evaluation of monocyclic pyrimidinones as novel inhibitors of PDE5. J.Med.Chem., 55, 2012
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4G68
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4G5J
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![BU of 4g5j by Molmil](/molmil-images/mine/4g5j) | Crystal structure of EGFR kinase in complex with BIBW2992 | 分子名称: | (2E)-N-{4-[(3-chloro-4-fluorophenyl)amino]-7-[(3S)-tetrahydrofuran-3-yloxy]quinazolin-6-yl}-4-(dimethylamino)but-2-enamide, Epidermal growth factor receptor, N-{4-[(3-chloro-4-fluorophenyl)amino]-7-[(3S)-tetrahydrofuran-3-yloxy]quinazolin-6-yl}-4-(dimethylamino)butanamide | 著者 | Solca, F, Dahl, G, Zoephel, A, Bader, G, Sanderson, M, Klein, C, Kraemer, O, Himmelsbach, F, Haaksma, E, Adolf, G.R. | 登録日 | 2012-07-18 | 公開日 | 2012-08-29 | 最終更新日 | 2012-10-31 | 実験手法 | X-RAY DIFFRACTION (2.8 Å) | 主引用文献 | Target Binding Properties and Cellular Activity of Afatinib (BIBW 2992), an Irreversible ErbB Family Blocker. J.Pharmacol.Exp.Ther., 343, 2012
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4GBD
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![BU of 4gbd by Molmil](/molmil-images/mine/4gbd) | Crystal Structure Of Adenosine Deaminase From Pseudomonas Aeruginosa Pao1 with bound Zn and methylthio-coformycin | 分子名称: | (8R)-3-(5-S-methyl-5-thio-beta-D-ribofuranosyl)-3,6,7,8-tetrahydroimidazo[4,5-d][1,3]diazepin-8-ol, PHOSPHATE ION, Putative uncharacterized protein, ... | 著者 | Ho, M, Guan, R, Almo, S.C, Schramm, V.L. | 登録日 | 2012-07-27 | 公開日 | 2013-06-12 | 最終更新日 | 2024-02-28 | 実験手法 | X-RAY DIFFRACTION (1.975 Å) | 主引用文献 | Methylthioadenosine deaminase in an alternative quorum sensing pathway in Pseudomonas aeruginosa. Biochemistry, 51, 2012
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3PE5
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![BU of 3pe5 by Molmil](/molmil-images/mine/3pe5) | Three-dimensional Structure of protein A7VV38_9CLOT from Clostridium leptum DSM 753, Northeast Structural Genomics Consortium Target QlR103 | 分子名称: | Uncharacterized protein | 著者 | Kuzin, A, Su, M, Seetharaman, J, Sahdev, S, Xiao, R, Ciccosanti, C, Wang, D, Everett, J.K, Nair, R, Acton, T.B, Rost, B, Montelione, G.T, Hunt, J.F, Tong, L, Northeast Structural Genomics Consortium (NESG) | 登録日 | 2010-10-25 | 公開日 | 2010-11-10 | 最終更新日 | 2012-02-22 | 実験手法 | X-RAY DIFFRACTION (2.381 Å) | 主引用文献 | Northeast Structural Genomics Consortium Target QlR103 To be published
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4G84
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![BU of 4g84 by Molmil](/molmil-images/mine/4g84) | Crystal structure of human HisRS | 分子名称: | CHLORIDE ION, Histidine--tRNA ligase, cytoplasmic, ... | 著者 | Wei, Z, Wu, J, Zhou, J.J, Yang, X.-L, Zhang, M, Schimmel, P. | 登録日 | 2012-07-21 | 公開日 | 2012-09-26 | 最終更新日 | 2023-09-13 | 実験手法 | X-RAY DIFFRACTION (2.4 Å) | 主引用文献 | Internally Deleted Human tRNA Synthetase Suggests Evolutionary Pressure for Repurposing. Structure, 20, 2012
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4G8R
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![BU of 4g8r by Molmil](/molmil-images/mine/4g8r) | Crystal Structure of a novel small molecule inactivator bound to plasminogen activator inhibitor-1 | 分子名称: | (2S)-3-({[3-(trifluoromethyl)phenoxy]carbonyl}amino)propane-1,2-diyl bis(3,4,5-trihydroxybenzoate), Plasminogen activator inhibitor-1, SULFATE ION | 著者 | Stuckey, J.A, Lawrence, D.A, Li, S.-H. | 登録日 | 2012-07-23 | 公開日 | 2013-12-25 | 最終更新日 | 2024-02-28 | 実験手法 | X-RAY DIFFRACTION (2.19 Å) | 主引用文献 | Mechanistic characterization and crystal structure of a small molecule inactivator bound to plasminogen activator inhibitor-1. Proc.Natl.Acad.Sci.USA, 110, 2013
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4GDA
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![BU of 4gda by Molmil](/molmil-images/mine/4gda) | Circular Permuted Streptavidin A50/N49 | 分子名称: | BIOTIN, ETHANOL, GLYCEROL, ... | 著者 | Le Trong, I, Chu, V, Xing, Y, Lybrand, T.P, Stayton, P.S, Stenkamp, R.E. | 登録日 | 2012-07-31 | 公開日 | 2013-06-05 | 最終更新日 | 2024-02-28 | 実験手法 | X-RAY DIFFRACTION (1 Å) | 主引用文献 | Structural consequences of cutting a binding loop: two circularly permuted variants of streptavidin. Acta Crystallogr.,Sect.D, 69, 2013
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4G9H
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![BU of 4g9h by Molmil](/molmil-images/mine/4g9h) | Crystal structure of glutahtione s-transferase homolog from yersinia pestis, target EFI-501894, with bound glutathione | 分子名称: | GLUTATHIONE, GLYCEROL, Glutathione S-transferase | 著者 | Vetting, M.W, Toro, R, Bhosle, R, Al Obaidi, N.F, Morisco, L.L, Wasserman, S.R, Sojitra, S, Washington, E, Scott Glenn, A, Chowdhury, S, Evans, B, Hammonds, J, Hillerich, B, Love, J, Seidel, R.D, Imker, H.J, Armstrong, R.N, Gerlt, J.A, Almo, S.C, Enzyme Function Initiative (EFI) | 登録日 | 2012-07-23 | 公開日 | 2012-08-15 | 最終更新日 | 2023-09-13 | 実験手法 | X-RAY DIFFRACTION (2.1 Å) | 主引用文献 | Crystal structure of glutahtione s-transferase homolog from yersinia pestis, target efi-501894, with bound glutathione To be Published
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4GF0
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![BU of 4gf0 by Molmil](/molmil-images/mine/4gf0) | Crystal structure of glutahtione transferase homolog from sulfitobacter, TARGET EFI-501084, with bound glutathione | 分子名称: | CHLORIDE ION, GLUTATHIONE, Glutathione S-transferase | 著者 | Vetting, M.W, Toro, R, Bhosle, R, Al Obaidi, N.F, Morisco, L.L, Wasserman, S.R, Sojitra, S, Washington, E, Scott Glenn, A, Chowdhury, S, Evans, B, Hammonds, J, Hillerich, B, Love, J, Seidel, R.D, Imker, H.J, Armstrong, R.N, Gerlt, J.A, Almo, S.C, Enzyme Function Initiative (EFI) | 登録日 | 2012-08-02 | 公開日 | 2012-08-29 | 最終更新日 | 2023-09-13 | 実験手法 | X-RAY DIFFRACTION (1.75 Å) | 主引用文献 | Crystal structure of glutahtione transferase homolog from sulfitobacter, TARGET EFI-501084, with bound glutathione To be Published
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3MER
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![BU of 3mer by Molmil](/molmil-images/mine/3mer) | Crystal Structure of the methyltransferase Slr1183 from Synechocystis sp. PCC 6803, Northeast Structural Genomics Consortium Target SgR145 | 分子名称: | Slr1183 protein | 著者 | Seetharaman, J, Chen, Y, Forouhar, F, Rossi, P, Sahdev, S, Xiao, R, Ciccosanti, C, Foote, E.L, Belote, R.L, Everett, J.K, Nair, R, Acton, T.B, Rost, B, Montelione, G.T, Hunt, J.F, Tong, L, Northeast Structural Genomics Consortium (NESG) | 登録日 | 2010-03-31 | 公開日 | 2010-04-14 | 最終更新日 | 2023-09-06 | 実験手法 | X-RAY DIFFRACTION (2.2 Å) | 主引用文献 | Northeast Structural Genomics Consortium Target SgR145 To be Published
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4GI0
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4FSJ
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![BU of 4fsj by Molmil](/molmil-images/mine/4fsj) | Crystal structure of the virus like particle of Flock House virus | 分子名称: | 4-(2-HYDROXYETHYL)-1-PIPERAZINE ETHANESULFONIC ACID, CALCIUM ION, CHLORIDE ION, ... | 著者 | Speir, J.A, Chen, Z, Reddy, V.S, Johnson, J.E. | 登録日 | 2012-06-27 | 公開日 | 2012-08-01 | 最終更新日 | 2024-04-03 | 実験手法 | X-RAY DIFFRACTION (3.5 Å) | 主引用文献 | Structural study of virus assembly intermediates reveals maturation event sequence and a staging position for externalized lytic peptides to be published, 2012
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4FT3
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![BU of 4ft3 by Molmil](/molmil-images/mine/4ft3) | Crystal Structure of the CHK1 | 分子名称: | 1-(5-chloro-2,4-dimethoxyphenyl)-3-pyrazin-2-ylurea, GLYCEROL, ISOPROPYL ALCOHOL, ... | 著者 | Kang, Y.N, Stuckey, J.A, Chang, P, Russell, A.J. | 登録日 | 2012-06-27 | 公開日 | 2012-08-22 | 実験手法 | X-RAY DIFFRACTION (2.5 Å) | 主引用文献 | Crystal Structure of the CHK1 To be Published
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4FTG
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4GKP
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4FUN
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![BU of 4fun by Molmil](/molmil-images/mine/4fun) | |
1YHH
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![BU of 1yhh by Molmil](/molmil-images/mine/1yhh) | |
4FV5
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4GM0
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![BU of 4gm0 by Molmil](/molmil-images/mine/4gm0) | Crystal Structure of Benzoylformate Decarboxylase Mutant L403N | 分子名称: | 2-{3-[(4-AMINO-2-METHYLPYRIMIDIN-5-YL)METHYL]-4-METHYL-2-OXO-2,3-DIHYDRO-1,3-THIAZOL-5-YL}ETHYL TRIHYDROGEN DIPHOSPHATE, Benzoylformate decarboxylase, CALCIUM ION, ... | 著者 | Novak, W.R.P, Andrews, F.H, Tom, A.R, Gunderman, P.R, McLeish, M.J. | 登録日 | 2012-08-15 | 公開日 | 2013-05-22 | 最終更新日 | 2023-09-13 | 実験手法 | X-RAY DIFFRACTION (1.07 Å) | 主引用文献 | A bulky hydrophobic residue is not required to maintain the v-conformation of enzyme-bound thiamin diphosphate. Biochemistry, 52, 2013
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3MAR
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![BU of 3mar by Molmil](/molmil-images/mine/3mar) | |
4FSM
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![BU of 4fsm by Molmil](/molmil-images/mine/4fsm) | Crystal Structure of the CHK1 | 分子名称: | 4-(6,7-dimethoxy-2,4-dihydroindeno[1,2-c]pyrazol-3-yl)phenol, GLYCEROL, ISOPROPYL ALCOHOL, ... | 著者 | Kang, Y.N, Stuckey, J.A, Chang, P, Russell, A.J. | 登録日 | 2012-06-27 | 公開日 | 2012-08-22 | 最終更新日 | 2023-11-29 | 実験手法 | X-RAY DIFFRACTION (2.3 Å) | 主引用文献 | Crystal Structure of the CHK1 To be Published
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4FT9
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4FTK
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![BU of 4ftk by Molmil](/molmil-images/mine/4ftk) | Crystal Structure of the CHK1 | 分子名称: | 3-(4'-hydroxybiphenyl-4-yl)-2,4-dihydroindeno[1,2-c]pyrazol-6-ol, ISOPROPYL ALCOHOL, SULFATE ION, ... | 著者 | Kang, Y.N, Stuckey, J.A, Chang, P, Russell, A.J. | 登録日 | 2012-06-27 | 公開日 | 2012-08-22 | 最終更新日 | 2023-11-29 | 実験手法 | X-RAY DIFFRACTION (2.3 Å) | 主引用文献 | Crystal Structure of the CHK1 To be Published
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